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LJNOFFWZYYPTQK-UHFFFAOYSA-N

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LJNOFFWZYYPTQK-UHFFFAOYSA-N
SpectraBase Compound ID 9Y2qmtH4nuV
InChI InChI=1S/C60H50/c1-2-12-52-42-25-27-44(28-26-42)54(52)14-5-6-16-56-46-33-35-48(36-34-46)58(56)18-9-10-20-60-50-39-37-49(38-40-50)59(60)19-8-7-17-57-47-31-29-45(30-32-47)55(57)15-4-3-13-53-43-23-21-41(22-24-43)51(53)11-1/h41-50H,21-40H2
InChIKey LJNOFFWZYYPTQK-UHFFFAOYSA-N
Mol Weight 771.1 g/mol
Molecular Formula C60H50
Exact Mass 770.391252 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JXlq48sAmMf
Name LJNOFFWZYYPTQK-UHFFFAOYSA-N
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H50
InChI InChI=1S/C60H50/c1-2-12-52-42-25-27-44(28-26-42)54(52)14-5-6-16-56-46-33-35-48(36-34-46)58(56)18-9-10-20-60-50-39-37-49(38-40-50)59(60)19-8-7-17-57-47-31-29-45(30-32-47)55(57)15-4-3-13-53-43-23-21-41(22-24-43)51(53)11-1/h41-50H,21-40H2
InChIKey LJNOFFWZYYPTQK-UHFFFAOYSA-N
Literature Reference Author T.NISHINAGA,T.KAWAMURA,K.KOMATSU
Literature Reference Citation J.ORG.CHEM.,62,5354(1997)
Literature Reference DOI 10.1021/jo9705531
Molecular Weight 771.057 g/mol
Solvent CDCl3
Source File Reference UWMZ4275